#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sxm s ILE 2 N 0.00 1.37 0.03 12.58 1.01 -1.26 -2.40 121.20 132.53 1sxm s ILE 2 Ca 0.00 -0.57 0.00 0.00 0.00 0.00 0.00 60.65 60.09 1sxm s ILE 2 Cb 0.00 -1.26 0.00 0.00 0.01 0.00 0.00 42.46 41.21 1sxm s ILE 2 CO 0.00 0.41 0.04 2.30 0.00 0.00 0.00 174.94 177.69 1sxm n ILE 3 N 4.20 0.00 -3.43 2.92 -5.35 -0.97 -4.95 119.36 111.78 1sxm n ILE 3 Ca -0.19 -0.11 -0.26 0.00 -0.27 0.00 0.00 62.75 61.92 1sxm n ILE 3 Cb 0.51 -0.85 -0.09 0.00 -1.74 0.00 0.00 39.64 37.46 1sxm n ILE 3 CO 0.00 0.00 0.00 -0.46 -1.76 0.00 0.00 176.55 174.33 1sxm n ASN 4 N -2.73 0.62 -4.04 7.28 0.23 -1.26 -4.32 115.26 111.05 1sxm n ASN 4 Ca 0.01 -2.68 -0.23 0.00 -0.53 0.00 0.00 54.58 51.14 1sxm n ASN 4 Cb 0.03 -0.62 -0.16 0.00 -2.08 0.00 0.00 39.78 36.95 1sxm n ASN 4 CO 0.00 0.00 0.00 -0.69 -0.93 0.00 0.00 177.26 175.64 1sxm s VAL 5 N -0.73 1.05 0.09 3.53 1.01 -1.26 -4.98 120.40 119.11 1sxm s VAL 5 Ca 0.33 -0.48 -0.28 0.00 0.00 0.00 0.00 61.98 61.55 1sxm s VAL 5 Cb 0.07 -0.94 -0.06 0.00 0.00 0.00 0.00 36.38 35.45 1sxm s VAL 5 CO -0.16 0.32 0.89 -0.54 0.00 0.00 0.00 175.10 175.62 1sxm s LYS 6 N 0.37 4.63 0.31 2.72 -0.14 -1.26 -1.35 119.74 125.01 1sxm s LYS 6 Ca -0.08 1.31 0.07 0.00 -1.36 0.00 0.00 55.97 55.91 1sxm s LYS 6 Cb -0.12 -3.37 -0.03 0.00 -1.68 0.00 0.00 37.83 32.63 1sxm s LYS 6 CO 0.02 0.25 0.27 0.00 -0.76 0.00 0.00 175.35 175.12 1sxm n THR 8 N -0.58 0.00 -4.19 0.00 -1.04 -1.26 -4.44 114.28 102.77 1sxm n THR 8 Ca 0.07 0.00 -0.23 0.00 -2.04 0.00 0.00 64.05 61.85 1sxm n THR 8 Cb 0.56 -0.13 -0.06 0.00 -1.82 0.00 0.00 70.33 68.88 1sxm n THR 8 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 1sxm s SER 9 N -2.76 4.76 0.33 8.00 1.04 -1.26 -5.05 113.70 118.76 1sxm s SER 9 Ca 0.00 -0.63 0.26 0.00 0.48 0.00 0.00 55.95 56.07 1sxm s SER 9 Cb 0.00 -0.89 1.02 0.00 0.10 0.00 0.00 66.02 66.25 1sxm s SER 9 CO 0.00 -0.12 1.78 -0.65 0.98 0.00 0.00 173.24 175.23 1sxm h PRO 10 N 1.69 0.00 0.00 4.02 0.11 -1.90 -2.98 132.00 132.94 1sxm h PRO 10 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1sxm h PRO 10 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 1sxm h PRO 10 CO 0.61 0.00 0.00 -0.22 -0.21 0.00 0.00 178.00 178.18 1sxm h LYS 11 N 0.00 0.00 -0.01 1.05 1.63 -1.96 -2.06 116.57 115.21 1sxm h LYS 11 Ca 0.00 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.80 1sxm h LYS 11 Cb 0.48 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.11 1sxm h LYS 11 CO 0.00 0.00 -0.13 0.94 -3.45 0.00 0.00 179.45 176.81 1sxm n GLN 12 N -2.62 1.12 -0.00 1.90 7.27 -1.13 -3.44 117.38 120.48 1sxm n GLN 12 Ca 0.03 -0.60 0.01 0.00 0.07 0.00 0.00 57.00 56.50 1sxm n GLN 12 Cb 0.36 -1.49 -0.01 0.00 2.41 0.00 0.00 30.24 31.52 1sxm n GLN 12 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1sxm n SER 14 N -1.15 0.88 -0.00 0.00 7.64 -0.79 -3.08 113.62 117.12 1sxm n SER 14 Ca 0.00 -1.21 -0.04 0.00 1.01 0.00 0.00 58.87 58.63 1sxm n SER 14 Cb 0.02 -0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.19 1sxm n SER 14 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 1sxm h LYS 15 N 1.35 -0.11 -0.19 1.43 1.57 -1.79 -3.12 116.57 115.71 1sxm h LYS 15 Ca 0.00 0.01 -0.18 0.00 -1.87 0.00 0.00 60.65 58.60 1sxm h LYS 15 Cb 0.32 0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.66 1sxm h LYS 15 CO 0.00 0.10 -0.63 -1.00 -0.57 0.00 0.00 179.45 177.35 1sxm h PRO 16 N -1.01 0.66 0.00 3.15 0.13 -1.84 -3.02 132.00 130.07 1sxm h PRO 16 Ca -0.01 -0.46 -0.08 0.00 -0.87 0.00 0.00 66.00 64.57 1sxm h PRO 16 Cb 0.26 0.07 -0.01 0.00 0.13 0.00 0.00 31.00 31.45 1sxm h PRO 16 CO 0.02 1.08 -0.40 0.00 -0.23 0.00 0.00 178.00 178.47 1sxm n LYS 18 N -3.72 0.16 0.13 0.00 5.02 -1.18 -0.81 118.16 117.77 1sxm n LYS 18 Ca -0.01 -0.08 0.12 0.00 -2.02 0.00 0.00 58.31 56.32 1sxm n LYS 18 Cb 0.48 -1.50 0.06 0.00 -0.02 0.00 0.00 35.03 34.05 1sxm n LYS 18 CO 0.00 0.00 0.00 1.49 -0.52 0.00 0.00 177.40 178.37 1sxm h GLU 19 N 0.20 0.00 0.00 1.97 4.81 -1.31 -3.20 114.58 117.05 1sxm h GLU 19 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1sxm h GLU 19 Cb 0.49 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.87 1sxm h GLU 19 CO 0.00 0.00 -0.20 1.28 -0.73 0.00 0.00 179.01 179.36 1sxm n LEU 20 N -2.73 0.50 0.01 1.64 4.77 -0.56 -4.76 117.00 115.86 1sxm n LEU 20 Ca 0.01 0.22 0.11 0.00 -0.03 0.00 0.00 56.01 56.32 1sxm n LEU 20 Cb 0.54 -0.58 0.10 0.00 -2.33 0.00 0.00 43.42 41.15 1sxm n LEU 20 CO 0.38 -0.47 0.22 -1.22 -1.33 0.00 0.00 177.39 174.98 1sxm n TYR 21 N -2.95 0.08 0.00 -1.77 4.02 0.01 -5.03 117.16 111.52 1sxm n TYR 21 Ca -0.03 0.02 0.00 0.00 -0.01 0.00 0.00 57.90 57.88 1sxm n TYR 21 Cb 0.10 -0.24 0.00 0.00 -0.02 0.00 0.00 39.34 39.18 1sxm n TYR 21 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1sxm n GLY 22 N 1.46 1.85 0.00 2.72 0.00 -1.21 -3.58 105.19 106.43 1sxm n GLY 22 Ca 0.04 -0.63 0.00 0.00 0.00 0.00 0.00 46.02 45.44 1sxm n GLY 22 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1sxm n SER 23 N 3.66 0.00 -3.50 1.61 7.64 -1.26 -4.62 113.62 117.15 1sxm n SER 23 Ca 0.00 -0.14 -0.36 0.00 1.01 0.00 0.00 58.87 59.38 1sxm n SER 23 Cb 0.00 0.00 -0.01 0.00 -1.01 0.00 0.00 64.21 63.19 1sxm n SER 23 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1sxm n SER 24 N 0.00 5.88 -4.16 6.43 2.88 -1.24 -4.95 113.62 118.48 1sxm n SER 24 Ca 0.00 -3.60 -0.29 0.00 -1.33 0.00 0.00 58.87 53.65 1sxm n SER 24 Cb 0.04 -0.96 -0.17 0.00 -0.75 0.00 0.00 64.21 62.37 1sxm n SER 24 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1sxm s ALA 25 N -3.52 1.84 0.12 -1.46 0.00 -1.26 -3.54 121.76 113.94 1sxm s ALA 25 Ca 0.40 -0.78 0.02 0.00 0.00 0.00 0.00 51.96 51.60 1sxm s ALA 25 Cb 0.18 -0.70 -0.04 0.00 0.00 0.00 0.00 23.12 22.56 1sxm s ALA 25 CO -0.06 0.24 0.21 0.20 0.00 0.00 0.00 175.76 176.35 1sxm s GLY 26 N 0.39 1.86 -0.22 0.00 0.00 -0.97 -4.17 107.32 104.20 1sxm s GLY 26 Ca -0.16 -1.02 -0.08 0.00 0.00 0.00 0.00 44.72 43.47 1sxm s GLY 26 CO 0.07 -1.01 0.48 0.00 0.00 0.00 0.00 173.10 172.63 1sxm s ALA 27 N -1.65 -1.39 -0.03 3.20 0.00 -1.26 -1.78 121.76 118.86 1sxm s ALA 27 Ca 0.33 1.73 0.05 0.00 0.00 0.00 0.00 51.96 54.08 1sxm s ALA 27 Cb -0.11 -1.43 -0.01 0.00 0.00 0.00 0.00 23.12 21.57 1sxm s ALA 27 CO 0.27 -0.78 -0.19 0.15 0.00 0.00 0.00 175.76 175.20 1sxm s LYS 28 N 2.64 1.78 -0.30 0.00 -0.14 -1.05 -4.86 119.74 117.81 1sxm s LYS 28 Ca -0.03 -0.69 0.01 0.00 -1.36 0.00 0.00 55.97 53.90 1sxm s LYS 28 Cb -0.12 -1.62 0.07 0.00 -1.68 0.00 0.00 37.83 34.48 1sxm s LYS 28 CO -0.14 0.35 -0.02 0.00 -0.76 0.00 0.00 175.35 174.78 1sxm s MET 30 N 1.10 3.43 0.16 0.00 -1.94 -1.08 -4.89 119.30 116.08 1sxm s MET 30 Ca -0.02 -0.61 0.00 0.00 -1.71 0.00 0.00 55.69 53.35 1sxm s MET 30 Cb -0.20 -2.99 0.00 0.00 2.01 0.00 0.00 34.83 33.65 1sxm s MET 30 CO -0.05 -0.11 0.00 0.27 -0.01 0.00 0.00 175.02 175.12 1sxm n ASN 31 N 4.56 0.00 -2.67 3.03 0.23 -1.26 -2.30 115.26 116.84 1sxm n ASN 31 Ca -0.18 0.00 -0.05 0.00 -0.53 0.00 0.00 54.58 53.83 1sxm n ASN 31 Cb 0.51 0.00 0.05 0.00 -2.08 0.00 0.00 39.78 38.26 1sxm n ASN 31 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1sxm n GLY 32 N 0.00 -0.44 3.32 4.83 0.00 -1.26 -4.83 105.19 106.81 1sxm n GLY 32 Ca 0.00 0.19 -0.14 0.00 0.00 0.00 0.00 46.02 46.07 1sxm n GLY 32 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1sxm s LYS 33 N 0.09 0.80 -0.02 1.61 1.02 -0.97 -3.25 119.74 119.02 1sxm s LYS 33 Ca 0.13 -0.12 -0.01 0.00 0.02 0.00 0.00 55.97 55.99 1sxm s LYS 33 Cb 0.20 0.36 -0.04 0.00 -0.52 0.00 0.00 37.83 37.84 1sxm s LYS 33 CO -0.08 -0.24 0.06 0.00 -0.92 0.00 0.00 175.35 174.18 1sxm s LYS 35 N -1.60 1.52 -0.10 0.00 1.02 -0.61 -2.30 119.74 117.67 1sxm s LYS 35 Ca 0.21 -1.05 0.03 0.00 0.02 0.00 0.00 55.97 55.18 1sxm s LYS 35 Cb -0.12 -1.70 0.01 0.00 -0.52 0.00 0.00 37.83 35.50 1sxm s LYS 35 CO 0.12 0.43 -0.18 0.00 -0.92 0.00 0.00 175.35 174.80 1sxm n TYR 37 N 3.91 0.00 -4.42 0.00 4.01 -0.73 -3.96 117.16 115.96 1sxm n TYR 37 Ca -0.20 0.00 -0.24 0.00 -0.16 0.00 0.00 57.90 57.30 1sxm n TYR 37 Cb 0.52 0.00 -0.17 0.00 -0.31 0.00 0.00 39.34 39.38 1sxm n TYR 37 CO 0.00 0.00 0.00 -0.80 -0.46 0.00 0.00 176.86 175.60 1sxm s ASN 38 N -0.15 1.62 0.00 7.72 -0.87 -1.26 -2.30 114.94 119.69 1sxm s ASN 38 Ca 0.00 -0.26 0.10 0.00 -1.57 0.00 0.00 52.86 51.13 1sxm s ASN 38 Cb 0.00 -0.74 0.08 0.00 -0.02 0.00 0.00 41.25 40.57 1sxm s ASN 38 CO 0.00 -0.00 0.81 0.59 -2.57 0.00 0.00 177.10 175.92